Match Hartree energy
Commits >
Commit babc485c55a2119a415aa56305cb49f398154cb7 >
Run spack_foss-2022a_cuda_serial >
Input 10-helium_upf.01-gs_nofilter.inp
Value | Reference | Precision | Status |
2.003281340000000e+00 | 2.003281330000000e+00 | 1.000000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)